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7A3W
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BU of 7a3w by Molmil
Structure of Imine Reductase from Pseudomonas sp.
Descriptor: 1,2-ETHANEDIOL, GLYCEROL, NAD(P)-dependent oxidoreductase, ...
Authors:Cuetos, A, Thorpe, T, Turner, N.J, Grogan, G.
Deposit date:2020-08-18
Release date:2021-08-25
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.59 Å)
Cite:Multifunctional biocatalyst for conjugate reduction and reductive amination.
Nature, 604, 2022
5A9T
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BU of 5a9t by Molmil
Imine Reductase from Amycolatopsis orientalis in complex with (R)- Methyltetrahydroisoquinoline
Descriptor: (1R)-1-methyl-1,2,3,4-tetrahydroisoquinoline, ACETATE ION, CALCIUM ION, ...
Authors:Man, H, Aleku, G, Turner, N.J, Grogan, G.
Deposit date:2015-07-22
Release date:2016-06-01
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Stereoselectivity and Structural Characterization of an Imine Reductase (Ired) from Amycolatopsis Orientalis
Acs Catalysis, 6, 2016
5A9R
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BU of 5a9r by Molmil
Apo form of Imine reductase from Amycolatopsis orientalis
Descriptor: ACETATE ION, IMINE REDUCTASE
Authors:Man, H, Aleku, G, Turner, N.J, Grogan, G.
Deposit date:2015-07-22
Release date:2016-06-01
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Stereoselectivity and Structural Characterization of an Imine Reductase (Ired) from Amycolatopsis Orientalis
Acs Catalysis, 6, 2016
5A9S
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BU of 5a9s by Molmil
NADPH complex of Imine Reductase from Amycolatopsis orientalis
Descriptor: CALCIUM ION, IMINE REDUCTASE, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
Authors:Man, H, Aleku, G, Turner, N.J, Grogan, G.
Deposit date:2015-07-22
Release date:2016-06-01
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.06 Å)
Cite:Stereoselectivity and Structural Characterization of an Imine Reductase (IRED) from Amycolatopsis orientalis
Acs Catalysis, 6, 2016
3ZDN
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BU of 3zdn by Molmil
D11-C mutant of monoamine oxidase from Aspergillus niger
Descriptor: 1,2-ETHANEDIOL, FLAVIN-ADENINE DINUCLEOTIDE, MONOAMINE OXIDASE N
Authors:Frank, A, Ghislieri, D, Willies, S, Turner, N.J, Grogan, G.
Deposit date:2012-11-29
Release date:2013-10-09
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.55 Å)
Cite:Engineering an Enantioselective Amine Oxidase for the Synthesis of Pharmaceutical Building Blocks and Alkaloid Natural Products.
J.Am.Chem.Soc., 135, 2013
6SLE
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BU of 6sle by Molmil
Structure of Reductive Aminase from Neosartorya fumigata in complex with NADP+
Descriptor: NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, Oxidoreductase, putative
Authors:Sharma, M, Mangas-Sanchez, J, Turner, N.J, Grogan, G.
Deposit date:2019-08-19
Release date:2020-06-24
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (2.77 Å)
Cite:Asymmetric synthesis of primary amines catalyzed by thermotolerant fungal reductive aminases.
Chem Sci, 11, 2020
6SKX
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BU of 6skx by Molmil
Structure of Reductive Aminase from Neosartorya fumigata
Descriptor: Oxidoreductase, putative
Authors:Sharma, M, Mangas-Sanchez, J, Turner, N.J, Grogan, G.
Deposit date:2019-08-16
Release date:2020-06-24
Last modified:2024-01-24
Method:X-RAY DIFFRACTION (2.25 Å)
Cite:Asymmetric synthesis of primary amines catalyzed by thermotolerant fungal reductive aminases.
Chem Sci, 11, 2020
6EOH
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BU of 6eoh by Molmil
Reductive Aminase from Aspergillus terreus in complex with NADPH and ethyl levulinate
Descriptor: NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, Reductive Aminase, ethyl levulinate
Authors:Sharma, M, Grogan, G, Mangas-Sanchez, J, Turner, N.J.
Deposit date:2017-10-09
Release date:2018-10-31
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:A Mechanism for Reductive Amination Catalyzed by Fungal Reductive Aminases
Acs Catalysis, 2018
2WQ8
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BU of 2wq8 by Molmil
Glycan labelling using engineered variants of galactose oxidase obtained by directed evolution
Descriptor: 1,2-ETHANEDIOL, ACETIC ACID, CALCIUM ION, ...
Authors:Rannes, J.G, Ioannou, A, Willies, S.C, Behrens, C, Grogan, G.J, Flitsch, S.L, Turner, N.J.
Deposit date:2009-08-14
Release date:2010-09-01
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.19 Å)
Cite:Glycoprotein Labeling Using Engineered Variants of Galactose Oxidase Obtained by Directed Evolution.
J.Am.Chem.Soc., 133, 2011
6EOI
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BU of 6eoi by Molmil
Reductive Aminase from Aspergillus terreus in complex with NADPH and ethyl-5-oxohexanoate
Descriptor: MAGNESIUM ION, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, Reductive Aminase, ...
Authors:Sharma, M, Mangas-Sanchez, J, Turner, N.J, Grogan, G.
Deposit date:2017-10-09
Release date:2018-10-31
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.76 Å)
Cite:A Mechanism for Reductive Amination Catalyzed by Fungal Reductive Aminases
Acs Catalysis, 2018
6EOD
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BU of 6eod by Molmil
Structure of Reductive Aminase from Aspergillus terreus in complex with NADPH
Descriptor: NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, Reductive Aminase
Authors:Sharma, M, Mangas-Sanchez, J, Turner, N.J, Grogan, G.
Deposit date:2017-10-09
Release date:2018-10-31
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:A Mechanism for Reductive Amination Catalyzed by Fungal Reductive Aminases
Acs Catalysis, 2018
6H7P
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BU of 6h7p by Molmil
Reductive Aminase from Aspergillus terreus in complex with NADPH4, cyclohexanone and allyl amine
Descriptor: CYCLOHEXANONE, Reductive Aminase, [[(2~{R},3~{S},4~{R},5~{R})-5-[(3~{R})-3-aminocarbonylpiperidin-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(2~{R},3~{R},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3-oxidanyl-4-phosphonooxy-oxolan-2-yl]methyl hydrogen phosphate, ...
Authors:Sharma, M, Grogan, G, Mangas-Sanchez, J, Turner, N.J.
Deposit date:2018-07-31
Release date:2019-04-03
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.79 Å)
Cite:Structure of Reductive Aminase from Aspergillus terreus
Acs Catalysis, 2018
5G0A
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BU of 5g0a by Molmil
The crystal structure of a S-selective transaminase from Bacillus megaterium
Descriptor: DI(HYDROXYETHYL)ETHER, PENTAETHYLENE GLYCOL, PYRIDOXAL-5'-PHOSPHATE, ...
Authors:van Oosterwijk, N, Willies, S, Hekelaar, J, Terwisscha van Scheltinga, A.C, Turner, N.J, Dijkstra, B.W.
Deposit date:2016-03-17
Release date:2016-07-27
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Structural Basis of Substrate Range and Enantioselectivity of Two S-Selective Omega- Transaminases
Biochemistry, 55, 2016
5FWN
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BU of 5fwn by Molmil
Imine Reductase from Amycolatopsis orientalis. Closed form in in complex with (R)- Methyltetrahydroisoquinoline
Descriptor: (1R)-1-methyl-1,2,3,4-tetrahydroisoquinoline, IMINE REDUCTASE, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
Authors:Man, H, Aleku, G, Turner, N.J, Grogan, G.
Deposit date:2016-02-18
Release date:2016-06-01
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.14 Å)
Cite:Stereoselectivity and Structural Characterization of an Imine Reductase (Ired) from Amycolatopsis Orientalis
Acs Catalysis, 6, 2016
5G09
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BU of 5g09 by Molmil
The crystal structure of a S-selective transaminase from Bacillus megaterium bound with R-alpha-methylbenzylamine
Descriptor: DI(HYDROXYETHYL)ETHER, PENTAETHYLENE GLYCOL, TETRAETHYLENE GLYCOL, ...
Authors:van Oosterwijk, N, Willies, S, Hekelaar, J, Terwisscha van Scheltinga, A.C, Turner, N.J, Dijkstra, B.W.
Deposit date:2016-03-17
Release date:2016-07-27
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Structural Basis of Substrate Range and Enantioselectivity of Two S-Selective Omega- Transaminases
Biochemistry, 55, 2016
5G6S
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BU of 5g6s by Molmil
Imine reductase from Aspergillus oryzae in complex with NADP(H) and (R)-rasagiline
Descriptor: IMINE REDUCTASE, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, RASAGILINE
Authors:Man, H, Aleku, G, Turner, N.J, Grogan, G.
Deposit date:2016-06-23
Release date:2017-05-31
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.35 Å)
Cite:A reductive aminase from Aspergillus oryzae.
Nat Chem, 9, 2017
5G6R
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BU of 5g6r by Molmil
Imine reductase from Aspergillus oryzae
Descriptor: IMINE REDUCTASE, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
Authors:Man, H, Aleku, G, Turner, N.J, Grogan, G.
Deposit date:2016-06-23
Release date:2017-05-31
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.82 Å)
Cite:A reductive aminase from Aspergillus oryzae.
Nat Chem, 9, 2017
5G2Q
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BU of 5g2q by Molmil
The crystal structure of a S-selective transaminase from Arthrobacter sp. with alanine bound
Descriptor: 2-[(3-HYDROXY-2-METHYL-5-PHOSPHONOOXYMETHYL-PYRIDIN-4-YLMETHYL)-AMINO]-PROPIONIC ACID, TRANSAMINASE
Authors:van Oosterwijk, N, Willies, S, Hekelaar, J, Terwisscha van Scheltinga, A.C, Turner, N.J, Dijkstra, B.W.
Deposit date:2016-04-12
Release date:2016-07-27
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.3 Å)
Cite:Structural Basis of Substrate Range and Enantioselectivity of Two S-Selective Omega- Transaminases
Biochemistry, 55, 2016
5G2P
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BU of 5g2p by Molmil
The crystal structure of a S-selective transaminase from Arthrobacter sp.
Descriptor: CHLORIDE ION, PYRIDOXAL-5'-PHOSPHATE, TRANSAMINASE
Authors:van Oosterwijk, N, Willies, S, Hekelaar, J, Terwisscha van Scheltinga, A.C, Turner, N.J, Dijkstra, B.W.
Deposit date:2016-04-12
Release date:2016-07-27
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.89 Å)
Cite:Structural Basis of Substrate Range and Enantioselectivity of Two S-Selective Omega- Transaminases
Biochemistry, 55, 2016
7OSN
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BU of 7osn by Molmil
IRED361 from Micromonospora sp. in complex with NADP+
Descriptor: 6-phosphogluconate dehydrogenase, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
Authors:Gilio, A.K, Harawa, V, Turner, N, Grogan, G.J.
Deposit date:2021-06-09
Release date:2022-06-22
Last modified:2024-01-31
Method:X-RAY DIFFRACTION (2.55 Å)
Cite:Synthesis of Stereoenriched Piperidines via Chemo-Enzymatic Dearomatization of Activated Pyridines.
J.Am.Chem.Soc., 144, 2022
3ZGY
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BU of 3zgy by Molmil
Apo-structure of R-selective imine reductase from Streptomyces kanamyceticus
Descriptor: R-IMINE REDUCTASE
Authors:Rodriguez Mata, M, Frank, A, Grogan, G.
Deposit date:2012-12-19
Release date:2013-07-17
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.71 Å)
Cite:Structure and Activity of Nadph-Dependent Reductase Q1Eqe0 from Streptomyces Kanamyceticus, which Catalyses the R-Selective Reduction of an Imine Substrate.
Chembiochem, 14, 2013
3ZHB
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BU of 3zhb by Molmil
R-imine reductase from Streptomyces kanamyceticus in complex with NADP.
Descriptor: NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, R-IMINE REDUCTASE
Authors:Rodriguez Mata, M, Frank, A, Grogan, G.
Deposit date:2012-12-20
Release date:2013-07-17
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (2.73 Å)
Cite:Structure and Activity of Nadph-Dependent Reductase Q1Eqe0 from Streptomyces Kanamyceticus, which Catalyses the R-Selective Reduction of an Imine Substrate.
Chembiochem, 14, 2013
8QHE
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BU of 8qhe by Molmil
Crystal structure IR-09
Descriptor: 6-phosphogluconate dehydrogenase NADP-binding domain-containing protein, MAGNESIUM ION, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, ...
Authors:Levy, C.W.
Deposit date:2023-09-07
Release date:2023-10-11
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Biocatalysis in Drug Design: Engineered Reductive Aminases (RedAms) Are Used to Access Chiral Building Blocks with Multiple Stereocenters.
J.Am.Chem.Soc., 145, 2023
2VVM
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BU of 2vvm by Molmil
The structure of MAO-N-D5, a variant of monoamine oxidase from Aspergillus niger.
Descriptor: 1,2-ETHANEDIOL, FLAVIN-ADENINE DINUCLEOTIDE, MONOAMINE OXIDASE N, ...
Authors:Atkin, K.E, Hart, S, Turkenburg, J.P, Brzozowski, A.M, Grogan, G.J.
Deposit date:2008-06-10
Release date:2008-11-04
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:The Structure of Monoamine Oxidase from Aspergillus Niger Provides a Molecular Context for Improvements in Activity Obtained by Directed Evolution.
J.Mol.Biol., 384, 2008
5LOC
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BU of 5loc by Molmil
Crystal structure of the engineered D-Amino Acid Dehydrogenase (DAADH)
Descriptor: Meso-diaminopimelate D-dehydrogenase
Authors:Dunstan, M.S, Gahloth, D.
Deposit date:2016-08-09
Release date:2017-08-16
Last modified:2019-10-16
Method:X-RAY DIFFRACTION (2.04 Å)
Cite:Single-biocatalyst synthesis of enantiopure D-arylalanines exploiting an engineered D-amino acid dehydrogenase
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